Molecule ID: mol29428

SMILES: CCC(NC(=O)CN)C(=O)O

InChI: InChI=1S/C6H12N2O3/c1-2-4(6(10)11)8-5(9)3-7/h4H,2-3,7H2,1H3,(H,8,9)(H,10,11)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.41 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization